1-(6-bromanyl-4-phenyl-2-piperidin-1-yl-quinolin-1-ium-3-yl)ethanone

Systemtic Name: 1-(6-bromanyl-4-phenyl-2-piperidin-1-yl-quinolin-1-ium-3-yl)ethanone Openeye Name: 1-[6-bromo-4-phenyl-2-(1-piperidyl)quinolin-1-ium-3-yl]ethanone CAS Name: 1-[6-bromo-4-phenyl-2-(1-piperidinyl)-3-quinolin-1-iumyl]ethanone IUPAC Name: 1-(6-bromo-4-phenyl-2-piperidin-1-ylquinolin-1-ium-3-yl)ethanone Traditional Name: 1-(6-bromo-4-phenyl-2-piperidino-quinolin-1-ium-3-yl)ethanone Formula: C22H22BrN2O+ MolecularWeight: 410.32688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C([NH+]=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)N4CCCCC4

Isomeric SMILES

CC(=O)C1=C([NH+]=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)N4CCCCC4

InChI

InChI=1S/C22H21BrN2O/c1-15(26)20-21(16-8-4-2-5-9-16)18-14-17(23)10-11-19(18)24-22(20)25-12-6-3-7-13-25/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3/p+1